methyl 7-[[4-[(aminocarbonylamino)methyl]phenyl]carbonylamino]heptanoate

Systemtic Name: methyl 7-[[4-[(aminocarbonylamino)methyl]phenyl]carbonylamino]heptanoate Openeye Name: methyl 7-[[4-(ureidomethyl)benzoyl]amino]heptanoate CAS Name: 7-[[[4-[(carbamoylamino)methyl]phenyl]-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[4-[(carbamoylamino)methyl]benzoyl]amino]heptanoate Traditional Name: 7-[[4-(ureidomethyl)benzoyl]amino]enanthic acid methyl ester Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCNC(=O)C1=CC=C(C=C1)CNC(=O)N

Isomeric SMILES

COC(=O)CCCCCCNC(=O)C1=CC=C(C=C1)CNC(=O)N

InChI

InChI=1S/C17H25N3O4/c1-24-15(21)6-4-2-3-5-11-19-16(22)14-9-7-13(8-10-14)12-20-17(18)23/h7-10H,2-6,11-12H2,1H3,(H,19,22)(H3,18,20,23)