5-nitro-1-(phenylmethyl)indole-3-carbaldehyde

Systemtic Name: 5-nitro-1-(phenylmethyl)indole-3-carbaldehyde Openeye Name: 1-benzyl-5-nitro-indole-3-carbaldehyde CAS Name: 5-nitro-1-(phenylmethyl)-3-indolecarboxaldehyde IUPAC Name: 1-benzyl-5-nitroindole-3-carbaldehyde Traditional Name: 1-benzyl-5-nitro-indole-3-carbaldehyde Formula: C16H12N2O3 MolecularWeight: 280.27808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)[N+](=O)[O-])C=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)[N+](=O)[O-])C=O

InChI

InChI=1S/C16H12N2O3/c19-11-13-10-17(9-12-4-2-1-3-5-12)16-7-6-14(18(20)21)8-15(13)16/h1-8,10-11H,9H2