methyl 2-[[1-(2-azanylethyl)cyclopentyl]carbonylamino]-3-(4-nitrophenyl)propanoate

Systemtic Name: methyl 2-[[1-(2-azanylethyl)cyclopentyl]carbonylamino]-3-(4-nitrophenyl)propanoate Openeye Name: methyl 2-[[1-(2-aminoethyl)cyclopentanecarbonyl]amino]-3-(4-nitrophenyl)propanoate CAS Name: 2-[[[1-(2-aminoethyl)cyclopentyl]-oxomethyl]amino]-3-(4-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[[1-(2-aminoethyl)cyclopentanecarbonyl]amino]-3-(4-nitrophenyl)propanoate Traditional Name: 2-[[1-(2-aminoethyl)cyclopentanecarbonyl]amino]-3-(4-nitrophenyl)propionic acid methyl ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2(CCCC2)CCN

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])NC(=O)C2(CCCC2)CCN

InChI

InChI=1S/C18H25N3O5/c1-26-16(22)15(12-13-4-6-14(7-5-13)21(24)25)20-17(23)18(10-11-19)8-2-3-9-18/h4-7,15H,2-3,8-12,19H2,1H3,(H,20,23)