ethyl 2-[[1-(2-azanyl-3-cyclopentyl-propanoyl)pyrrolidin-2-yl]carbonyl-phenylmethoxycarbonyl-amino]-5-[bis(azanyl)methylideneamino]-2-methanoyl-pentanoate

Systemtic Name: ethyl 2-[[1-(2-azanyl-3-cyclopentyl-propanoyl)pyrrolidin-2-yl]carbonyl-phenylmethoxycarbonyl-amino]-5-[bis(azanyl)methylideneamino]-2-methanoyl-pentanoate Openeye Name: ethyl 2-[[1-(2-amino-3-cyclopentyl-propanoyl)pyrrolidine-2-carbonyl]-benzyloxycarbonyl-amino]-2-formyl-5-guanidino-pentanoate CAS Name: 2-[[[1-(2-amino-3-cyclopentyl-1-oxopropyl)-2-pyrrolidinyl]-oxomethyl]-phenylmethoxycarbonylamino]-5-(diaminomethylideneamino)-2-formylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[[1-(2-amino-3-cyclopentylpropanoyl)pyrrolidine-2-carbonyl]-phenylmethoxycarbonylamino]-5-(diaminomethylideneamino)-2-formylpentanoate Traditional Name: 2-[[1-(2-amino-3-cyclopentyl-propanoyl)prolyl]-carbobenzoxy-amino]-2-formyl-5-guanidino-valeric acid ethyl ester Formula: C30H44N6O7 MolecularWeight: 600.70636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCN=C(N)N)(C=O)N(C(=O)C1CCCN1C(=O)C(CC2CCCC2)N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(CCCN=C(N)N)(C=O)N(C(=O)C1CCCN1C(=O)C(CC2CCCC2)N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C30H44N6O7/c1-2-42-27(40)30(20-37,15-9-16-34-28(32)33)36(29(41)43-19-22-12-4-3-5-13-22)26(39)24-14-8-17-35(24)25(38)23(31)18-21-10-6-7-11-21/h3-5,12-13,20-21,23-24H,2,6-11,14-19,31H2,1H3,(H4,32,33,34)