1-[(3-chlorophenyl)methyl]-3-methanoyl-indole-2-carboxylate

Systemtic Name: 1-[(3-chlorophenyl)methyl]-3-methanoyl-indole-2-carboxylate Openeye Name: 1-[(3-chlorophenyl)methyl]-3-formyl-indole-2-carboxylate CAS Name: 1-[(3-chlorophenyl)methyl]-3-formyl-2-indolecarboxylate IUPAC Name: 1-[(3-chlorophenyl)methyl]-3-formylindole-2-carboxylate Traditional Name: 1-(3-chlorobenzyl)-3-formyl-indole-2-carboxylate Formula: C17H11ClNO3- MolecularWeight: 312.72714

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2CC3=CC(=CC=C3)Cl)C(=O)[O-])C=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2CC3=CC(=CC=C3)Cl)C(=O)[O-])C=O

InChI

InChI=1S/C17H12ClNO3/c18-12-5-3-4-11(8-12)9-19-15-7-2-1-6-13(15)14(10-20)16(19)17(21)22/h1-8,10H,9H2,(H,21,22)/p-1