methyl 4-[[[2-azanyl-5-[(4-methoxyphenyl)methylcarbamoyl]phenyl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[2-azanyl-5-[(4-methoxyphenyl)methylcarbamoyl]phenyl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-amino-5-[(4-methoxyphenyl)methylcarbamoyl]benzoyl]amino]methyl]benzoate CAS Name: 4-[[[[2-amino-5-[[(4-methoxyphenyl)methylamino]-oxomethyl]phenyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-amino-5-[(4-methoxyphenyl)methylcarbamoyl]benzoyl]amino]methyl]benzoate Traditional Name: 4-[[[2-amino-5-(p-anisylcarbamoyl)benzoyl]amino]methyl]benzoic acid methyl ester Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)N)C(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)N)C(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C25H25N3O5/c1-32-20-10-5-17(6-11-20)14-27-23(29)19-9-12-22(26)21(13-19)24(30)28-15-16-3-7-18(8-4-16)25(31)33-2/h3-13H,14-15,26H2,1-2H3,(H,27,29)(H,28,30)