3-[(2,2-diphenylcyclopropyl)methylamino]propyl 3,4,5-trimethoxybenzoate hydrochloride

Systemtic Name: 3-[(2,2-diphenylcyclopropyl)methylamino]propyl 3,4,5-trimethoxybenzoate hydrochloride Openeye Name: 3-[(2,2-diphenylcyclopropyl)methylamino]propyl 3,4,5-trimethoxybenzoate hydrochloride CAS Name: 3,4,5-trimethoxybenzoic acid 3-[(2,2-diphenylcyclopropyl)methylamino]propyl ester hydrochloride IUPAC Name: 3-[(2,2-diphenylcyclopropyl)methylamino]propyl 3,4,5-trimethoxybenzoate hydrochloride Traditional Name: 3,4,5-trimethoxybenzoic acid 3-[(2,2-diphenylcyclopropyl)methylamino]propyl ester hydrochloride Formula: C29H34ClNO5 MolecularWeight: 512.03696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCCCNCC2CC2(C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCCCNCC2CC2(C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C29H33NO5.ClH/c1-32-25-17-21(18-26(33-2)27(25)34-3)28(31)35-16-10-15-30-20-24-19-29(24,22-11-6-4-7-12-22)23-13-8-5-9-14-23;/h4-9,11-14,17-18,24,30H,10,15-16,19-20H2,1-3H3;1H