ethyl 6-[2,2-diethoxyethyl(prop-2-enyl)amino]-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: ethyl 6-[2,2-diethoxyethyl(prop-2-enyl)amino]-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: ethyl 6-[allyl(2,2-diethoxyethyl)amino]-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 6-[2,2-diethoxyethyl(prop-2-enyl)amino]-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[2,2-diethoxyethyl(prop-2-enyl)amino]-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 6-[allyl(2,2-diethoxyethyl)amino]-9H-$b-carboline-3-carboxylic acid ethyl ester Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CN(CC=C)C1=CC2=C(C=C1)NC3=CN=C(C=C23)C(=O)OCC)OCC

Isomeric SMILES

CCOC(CN(CC=C)C1=CC2=C(C=C1)NC3=CN=C(C=C23)C(=O)OCC)OCC

InChI

InChI=1S/C23H29N3O4/c1-5-11-26(15-22(28-6-2)29-7-3)16-9-10-19-17(12-16)18-13-20(23(27)30-8-4)24-14-21(18)25-19/h5,9-10,12-14,22,25H,1,6-8,11,15H2,2-4H3