methyl 4,5-dimethoxy-2-[[1-(naphthalen-1-ylmethyl)piperidin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[[1-(naphthalen-1-ylmethyl)piperidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[1-(1-naphthylmethyl)piperidine-3-carbonyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[[1-(1-naphthalenylmethyl)-3-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[[1-(naphthalen-1-ylmethyl)piperidine-3-carbonyl]amino]benzoate Traditional Name: 4,5-dimethoxy-2-[[1-(1-naphthylmethyl)nipecotoyl]amino]benzoic acid methyl ester Formula: C27H30N2O5 MolecularWeight: 462.5375

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCCN(C2)CC3=CC=CC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCCN(C2)CC3=CC=CC4=CC=CC=C43)OC

InChI

InChI=1S/C27H30N2O5/c1-32-24-14-22(27(31)34-3)23(15-25(24)33-2)28-26(30)20-11-7-13-29(17-20)16-19-10-6-9-18-8-4-5-12-21(18)19/h4-6,8-10,12,14-15,20H,7,11,13,16-17H2,1-3H3,(H,28,30)