methyl 2-[2-(1H-indol-3-yl)ethylcarbamoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[2-(1H-indol-3-yl)ethylcarbamoylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[2-(1H-indol-3-yl)ethylcarbamoylamino]-4,5-dimethoxy-benzoate CAS Name: 2-[[[2-(1H-indol-3-yl)ethylamino]-oxomethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[2-(1H-indol-3-yl)ethylcarbamoylamino]-4,5-dimethoxybenzoate Traditional Name: 2-[2-(1H-indol-3-yl)ethylcarbamoylamino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)NCCC2=CNC3=CC=CC=C32)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)NCCC2=CNC3=CC=CC=C32)OC

InChI

InChI=1S/C21H23N3O5/c1-27-18-10-15(20(25)29-3)17(11-19(18)28-2)24-21(26)22-9-8-13-12-23-16-7-5-4-6-14(13)16/h4-7,10-12,23H,8-9H2,1-3H3,(H2,22,24,26)