8-[bis(prop-2-enyl)amino]-5H-pyrimido[5,4-b]indole-2-carboxylic acid

Systemtic Name: 8-[bis(prop-2-enyl)amino]-5H-pyrimido[5,4-b]indole-2-carboxylic acid Openeye Name: 8-(diallylamino)-5H-pyrimido[5,4-b]indole-2-carboxylic acid CAS Name: 8-[bis(prop-2-enyl)amino]-5H-pyrimido[5,4-b]indole-2-carboxylic acid IUPAC Name: 8-[bis(prop-2-enyl)amino]-5H-pyrimido[5,4-b]indole-2-carboxylic acid Traditional Name: 8-(diallylamino)-5H-pyrimid[5,4-b]indole-2-carboxylic acid Formula: C17H16N4O2 MolecularWeight: 308.33454

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=C)C1=CC2=C(C=C1)NC3=CN=C(N=C23)C(=O)O

Isomeric SMILES

C=CCN(CC=C)C1=CC2=C(C=C1)NC3=CN=C(N=C23)C(=O)O

InChI

InChI=1S/C17H16N4O2/c1-3-7-21(8-4-2)11-5-6-13-12(9-11)15-14(19-13)10-18-16(20-15)17(22)23/h3-6,9-10,19H,1-2,7-8H2,(H,22,23)