3-azanyl-4-[2-(3,4-dimethoxyphenyl)ethyl]pyrazino[2,3-b]indole-2-carbonitrile

Systemtic Name: 3-azanyl-4-[2-(3,4-dimethoxyphenyl)ethyl]pyrazino[2,3-b]indole-2-carbonitrile Openeye Name: 3-amino-4-[2-(3,4-dimethoxyphenyl)ethyl]pyrazino[2,3-b]indole-2-carbonitrile CAS Name: 3-amino-4-[2-(3,4-dimethoxyphenyl)ethyl]-2-pyrazino[2,3-b]indolecarbonitrile IUPAC Name: 3-amino-4-[2-(3,4-dimethoxyphenyl)ethyl]pyrazino[2,3-b]indole-2-carbonitrile Traditional Name: 3-amino-4-homoveratryl-pyrazin[2,3-b]indole-2-carbonitrile Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=C(N=C3C2=NC4=CC=CC=C43)C#N)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=C(N=C3C2=NC4=CC=CC=C43)C#N)N)OC

InChI

InChI=1S/C21H19N5O2/c1-27-17-8-7-13(11-18(17)28-2)9-10-26-20(23)16(12-22)24-19-14-5-3-4-6-15(14)25-21(19)26/h3-8,11H,9-10,23H2,1-2H3