2-azanyl-3-(3,4-dimethoxyphenyl)carbonyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile

Systemtic Name: 2-azanyl-3-(3,4-dimethoxyphenyl)carbonyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile Openeye Name: 2-amino-3-(3,4-dimethoxybenzoyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile CAS Name: 2-amino-3-[(3,4-dimethoxyphenyl)-oxomethyl]-5,6,7,8-tetrahydroindolizine-1-carbonitrile IUPAC Name: 2-amino-3-(3,4-dimethoxybenzoyl)-5,6,7,8-tetrahydroindolizine-1-carbonitrile Traditional Name: 2-amino-3-veratroyl-5,6,7,8-tetrahydroindolizine-1-carbonitrile Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2=C(C(=C3N2CCCC3)C#N)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C2=C(C(=C3N2CCCC3)C#N)N)OC

InChI

InChI=1S/C18H19N3O3/c1-23-14-7-6-11(9-15(14)24-2)18(22)17-16(20)12(10-19)13-5-3-4-8-21(13)17/h6-7,9H,3-5,8,20H2,1-2H3