butanedioic acid; (2,5-dimethyl-1-prop-2-enyl-piperidin-4-yl) benzoate

Systemtic Name: butanedioic acid; (2,5-dimethyl-1-prop-2-enyl-piperidin-4-yl) benzoate Openeye Name: (1-allyl-2,5-dimethyl-4-piperidyl) benzoate; succinic acid CAS Name: benzoic acid (2,5-dimethyl-1-prop-2-enyl-4-piperidinyl) ester; butanedioic acid IUPAC Name: butanedioic acid; (2,5-dimethyl-1-prop-2-enylpiperidin-4-yl) benzoate Traditional Name: benzoic acid (1-allyl-2,5-dimethyl-4-piperidyl) ester; succinic acid Formula: C21H29NO6 MolecularWeight: 391.45806

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(CN1CC=C)C)OC(=O)C2=CC=CC=C2.C(CC(=O)O)C(=O)O

Isomeric SMILES

CC1CC(C(CN1CC=C)C)OC(=O)C2=CC=CC=C2.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C17H23NO2.C4H6O4/c1-4-10-18-12-13(2)16(11-14(18)3)20-17(19)15-8-6-5-7-9-15;5-3(6)1-2-4(7)8/h4-9,13-14,16H,1,10-12H2,2-3H3;1-2H2,(H,5,6)(H,7,8)