2-[3-[4-(diphenylmethyl)-1,4-diazepan-1-yl]propoxy]naphthalene-1-carboxylic acid

Systemtic Name: 2-[3-[4-(diphenylmethyl)-1,4-diazepan-1-yl]propoxy]naphthalene-1-carboxylic acid Openeye Name: 2-[3-(4-benzhydryl-1,4-diazepan-1-yl)propoxy]naphthalene-1-carboxylic acid CAS Name: 2-[3-[4-(diphenylmethyl)-1,4-diazepan-1-yl]propoxy]-1-naphthalenecarboxylic acid IUPAC Name: 2-[3-(4-benzhydryl-1,4-diazepan-1-yl)propoxy]naphthalene-1-carboxylic acid Traditional Name: 2-[3-(4-benzhydryl-1,4-diazepan-1-yl)propoxy]-1-naphthoic acid Formula: C32H34N2O3 MolecularWeight: 494.62396

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3)CCCOC4=C(C5=CC=CC=C5C=C4)C(=O)O

Isomeric SMILES

C1CN(CCN(C1)C(C2=CC=CC=C2)C3=CC=CC=C3)CCCOC4=C(C5=CC=CC=C5C=C4)C(=O)O

InChI

InChI=1S/C32H34N2O3/c35-32(36)30-28-16-8-7-11-25(28)17-18-29(30)37-24-10-20-33-19-9-21-34(23-22-33)31(26-12-3-1-4-13-26)27-14-5-2-6-15-27/h1-8,11-18,31H,9-10,19-24H2,(H,35,36)