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

Systemtic Name: [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenyl-piperidin-4-yl] 4-azanylbenzoate Openeye Name: [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenyl-4-piperidyl] 4-aminobenzoate CAS Name: 4-aminobenzoic acid [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenyl-4-piperidinyl] ester IUPAC Name: [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenylpiperidin-4-yl] 4-aminobenzoate Traditional Name: 4-aminobenzoic acid [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenyl-4-piperidyl] ester Formula: C28H41N3O2 MolecularWeight: 451.64404

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CC1(CN(C(CC1(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)N)C)C)C

Isomeric SMILES

CCCN(CCC)CC1(CN(C(CC1(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)N)C)C)C

InChI

InChI=1S/C28H41N3O2/c1-6-17-31(18-7-2)21-27(4)20-30(5)22(3)19-28(27,24-11-9-8-10-12-24)33-26(32)23-13-15-25(29)16-14-23/h8-16,22H,6-7,17-21,29H2,1-5H3