8-phenylmethoxycarbonyl-5H-pyrimido[5,4-b]indole-2-carboxylic acid

Systemtic Name: 8-phenylmethoxycarbonyl-5H-pyrimido[5,4-b]indole-2-carboxylic acid Openeye Name: 8-benzyloxycarbonyl-5H-pyrimido[5,4-b]indole-2-carboxylic acid CAS Name: 8-phenylmethoxycarbonyl-5H-pyrimido[5,4-b]indole-2-carboxylic acid IUPAC Name: 8-phenylmethoxycarbonyl-5H-pyrimido[5,4-b]indole-2-carboxylic acid Traditional Name: 8-carbobenzoxy-5H-pyrimid[5,4-b]indole-2-carboxylic acid Formula: C19H13N3O4 MolecularWeight: 347.32422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC3=C(C=C2)NC4=CN=C(N=C34)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC3=C(C=C2)NC4=CN=C(N=C34)C(=O)O

InChI

InChI=1S/C19H13N3O4/c23-18(24)17-20-9-15-16(22-17)13-8-12(6-7-14(13)21-15)19(25)26-10-11-4-2-1-3-5-11/h1-9,21H,10H2,(H,23,24)