4-[ethyl-(phenylmethyl)amino]butyl 3,4,5-trimethoxybenzoate

Systemtic Name: 4-[ethyl-(phenylmethyl)amino]butyl 3,4,5-trimethoxybenzoate Openeye Name: 4-[benzyl(ethyl)amino]butyl 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid 4-[ethyl-(phenylmethyl)amino]butyl ester IUPAC Name: 4-[benzyl(ethyl)amino]butyl 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid 4-[benzyl(ethyl)amino]butyl ester Formula: C23H31NO5 MolecularWeight: 401.49594

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)CC2=CC=CC=C2

Isomeric SMILES

CCN(CCCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)CC2=CC=CC=C2

InChI

InChI=1S/C23H31NO5/c1-5-24(17-18-11-7-6-8-12-18)13-9-10-14-29-23(25)19-15-20(26-2)22(28-4)21(16-19)27-3/h6-8,11-12,15-16H,5,9-10,13-14,17H2,1-4H3