methyl 4-[[[(2-oxidanylnaphthalen-1-yl)-phenyl-methyl]carbamoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[(2-oxidanylnaphthalen-1-yl)-phenyl-methyl]carbamoylamino]methyl]benzoate Openeye Name: methyl 4-[[[(2-hydroxy-1-naphthyl)-phenyl-methyl]carbamoylamino]methyl]benzoate CAS Name: 4-[[[[[(2-hydroxy-1-naphthalenyl)-phenylmethyl]amino]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(2-hydroxynaphthalen-1-yl)-phenylmethyl]carbamoylamino]methyl]benzoate Traditional Name: 4-[[[(2-hydroxy-1-naphthyl)-phenyl-methyl]carbamoylamino]methyl]benzoic acid methyl ester Formula: C27H24N2O4 MolecularWeight: 440.49046

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)NC(C2=CC=CC=C2)C3=C(C=CC4=CC=CC=C43)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)NC(C2=CC=CC=C2)C3=C(C=CC4=CC=CC=C43)O

InChI

InChI=1S/C27H24N2O4/c1-33-26(31)21-13-11-18(12-14-21)17-28-27(32)29-25(20-8-3-2-4-9-20)24-22-10-6-5-7-19(22)15-16-23(24)30/h2-16,25,30H,17H2,1H3,(H2,28,29,32)