ethyl 4-[[1-[(2-aminophenyl)-methyl-amino]cyclopropyl]-cyclopentyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[1-[(2-aminophenyl)-methyl-amino]cyclopropyl]-cyclopentyl-amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[1-(2-amino-N-methyl-anilino)cyclopropyl]-cyclopentyl-amino]-4-oxo-butanoate CAS Name: 4-[[1-(2-amino-N-methylanilino)cyclopropyl]-cyclopentylamino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[1-(2-amino-N-methylanilino)cyclopropyl]-cyclopentylamino]-4-oxobutanoate Traditional Name: 4-[[1-(2-amino-N-methyl-anilino)cyclopropyl]-cyclopentyl-amino]-4-keto-butyric acid ethyl ester Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(C1CCCC1)C2(CC2)N(C)C3=CC=CC=C3N

Isomeric SMILES

CCOC(=O)CCC(=O)N(C1CCCC1)C2(CC2)N(C)C3=CC=CC=C3N

InChI

InChI=1S/C21H31N3O3/c1-3-27-20(26)13-12-19(25)24(16-8-4-5-9-16)21(14-15-21)23(2)18-11-7-6-10-17(18)22/h6-7,10-11,16H,3-5,8-9,12-15,22H2,1-2H3