methyl 3-[4-[3-[4-(aminomethyl)phenyl]-2-oxidanylidene-imidazolidin-4-yl]phenyl]-2-azanyl-propanoate

Systemtic Name: methyl 3-[4-[3-[4-(aminomethyl)phenyl]-2-oxidanylidene-imidazolidin-4-yl]phenyl]-2-azanyl-propanoate Openeye Name: methyl 2-amino-3-[4-[3-[4-(aminomethyl)phenyl]-2-oxo-imidazolidin-4-yl]phenyl]propanoate CAS Name: 2-amino-3-[4-[3-[4-(aminomethyl)phenyl]-2-oxo-4-imidazolidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[4-[3-[4-(aminomethyl)phenyl]-2-oxoimidazolidin-4-yl]phenyl]propanoate Traditional Name: 2-amino-3-[4-[3-[4-(aminomethyl)phenyl]-2-keto-imidazolidin-4-yl]phenyl]propionic acid methyl ester Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)C2CNC(=O)N2C3=CC=C(C=C3)CN)N

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)C2CNC(=O)N2C3=CC=C(C=C3)CN)N

InChI

InChI=1S/C20H24N4O3/c1-27-19(25)17(22)10-13-2-6-15(7-3-13)18-12-23-20(26)24(18)16-8-4-14(11-21)5-9-16/h2-9,17-18H,10-12,21-22H2,1H3,(H,23,26)