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2-(6-azanyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)ethanenitrile; ethanedioic acid

2-(6-azanyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)ethanenitrile; ethanedioic acid

Systemtic Name:2-(6-azanyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)ethanenitrile; ethanedioic acid
Openeye Name:2-(6-amino-6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile; oxalic acid
CAS Name:2-(6-amino-6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile; oxalic acid
IUPAC Name:2-(6-amino-6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile; oxalic acid
Traditional Name:2-(6-amino-6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile; oxalic acid
Formula: C16H17N3O4
MolecularWeight: 315.32388
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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1N)C3=C(N2)C=CC(=C3)CC#N.C(=O)(C(=O)O)O


Isomeric SMILES

C1CC2=C(CC1N)C3=C(N2)C=CC(=C3)CC#N.C(=O)(C(=O)O)O


InChI

InChI=1S/C14H15N3.C2H2O4/c15-6-5-9-1-3-13-11(7-9)12-8-10(16)2-4-14(12)17-13;3-1(4)2(5)6/h1,3,7,10,17H,2,4-5,8,16H2;(H,3,4)(H,5,6)


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