[1,2,5-trimethyl-4-phenyl-5-(piperidin-1-ylmethyl)piperidin-4-yl] 4-azanylbenzoate

Systemtic Name: [1,2,5-trimethyl-4-phenyl-5-(piperidin-1-ylmethyl)piperidin-4-yl] 4-azanylbenzoate Openeye Name: [1,2,5-trimethyl-4-phenyl-5-(1-piperidylmethyl)-4-piperidyl] 4-aminobenzoate CAS Name: 4-aminobenzoic acid [1,2,5-trimethyl-4-phenyl-5-(1-piperidinylmethyl)-4-piperidinyl] ester IUPAC Name: [1,2,5-trimethyl-4-phenyl-5-(piperidin-1-ylmethyl)piperidin-4-yl] 4-aminobenzoate Traditional Name: 4-aminobenzoic acid [1,2,5-trimethyl-4-phenyl-5-(piperidinomethyl)-4-piperidyl] ester Formula: C27H37N3O2 MolecularWeight: 435.60158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(CN1C)(C)CN2CCCCC2)(C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)N

Isomeric SMILES

CC1CC(C(CN1C)(C)CN2CCCCC2)(C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C27H37N3O2/c1-21-18-27(23-10-6-4-7-11-23,32-25(31)22-12-14-24(28)15-13-22)26(2,19-29(21)3)20-30-16-8-5-9-17-30/h4,6-7,10-15,21H,5,8-9,16-20,28H2,1-3H3