[2-[2-[(4-carbamimidoylphenyl)methylcarbamoyl]pyrrolidin-1-yl]-1-cyclohexyl-2-oxidanylidene-ethyl] ethanoate

Systemtic Name: [2-[2-[(4-carbamimidoylphenyl)methylcarbamoyl]pyrrolidin-1-yl]-1-cyclohexyl-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-[2-[(4-carbamimidoylphenyl)methylcarbamoyl]pyrrolidin-1-yl]-1-cyclohexyl-2-oxo-ethyl] acetate CAS Name: acetic acid [2-[2-[[(4-carbamimidoylphenyl)methylamino]-oxomethyl]-1-pyrrolidinyl]-1-cyclohexyl-2-oxoethyl] ester IUPAC Name: [2-[2-[(4-carbamimidoylphenyl)methylcarbamoyl]pyrrolidin-1-yl]-1-cyclohexyl-2-oxoethyl] acetate Traditional Name: acetic acid [2-[2-[(4-amidinobenzyl)carbamoyl]pyrrolidino]-1-cyclohexyl-2-keto-ethyl] ester Formula: C23H32N4O4 MolecularWeight: 428.52458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1CCCCC1)C(=O)N2CCCC2C(=O)NCC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(=O)OC(C1CCCCC1)C(=O)N2CCCC2C(=O)NCC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H32N4O4/c1-15(28)31-20(17-6-3-2-4-7-17)23(30)27-13-5-8-19(27)22(29)26-14-16-9-11-18(12-10-16)21(24)25/h9-12,17,19-20H,2-8,13-14H2,1H3,(H3,24,25)(H,26,29)