N-benzo[a]pyren-1-ylethanamide

Systemtic Name: N-benzo[a]pyren-1-ylethanamide Openeye Name: N-benzo[a]pyren-1-ylacetamide CAS Name: N-(1-benzo[a]pyrenyl)acetamide IUPAC Name: N-benzo[a]pyren-1-ylacetamide Traditional Name: N-benzo[a]pyren-1-ylacetamide Formula: C22H15NO MolecularWeight: 309.3606

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C=CC3=C4C2=C(C=CC4=CC5=CC=CC=C35)C=C1

Isomeric SMILES

CC(=O)NC1=C2C=CC3=C4C2=C(C=CC4=CC5=CC=CC=C35)C=C1

InChI

InChI=1S/C22H15NO/c1-13(24)23-20-11-8-14-6-7-16-12-15-4-2-3-5-17(15)18-9-10-19(20)21(14)22(16)18/h2-12H,1H3,(H,23,24)