4-[[3-(1H-indol-3-yl)-3-oxidanylidene-propyl]carbamoyl]hexyl 3,4,5-trimethoxybenzoate

Systemtic Name: 4-[[3-(1H-indol-3-yl)-3-oxidanylidene-propyl]carbamoyl]hexyl 3,4,5-trimethoxybenzoate Openeye Name: 4-[[3-(1H-indol-3-yl)-3-oxo-propyl]carbamoyl]hexyl 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid 4-[[[3-(1H-indol-3-yl)-3-oxopropyl]amino]-oxomethyl]hexyl ester IUPAC Name: 4-[[3-(1H-indol-3-yl)-3-oxopropyl]carbamoyl]hexyl 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid 4-[[3-(1H-indol-3-yl)-3-keto-propyl]carbamoyl]hexyl ester Formula: C28H34N2O7 MolecularWeight: 510.57876

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)C(=O)NCCC(=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

CCC(CCCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC)C(=O)NCCC(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C28H34N2O7/c1-5-18(27(32)29-13-12-23(31)21-17-30-22-11-7-6-10-20(21)22)9-8-14-37-28(33)19-15-24(34-2)26(36-4)25(16-19)35-3/h6-7,10-11,15-18,30H,5,8-9,12-14H2,1-4H3,(H,29,32)