2-azanyl-3-phenyl-N-pyren-2-yl-propanamide

Systemtic Name: 2-azanyl-3-phenyl-N-pyren-2-yl-propanamide Openeye Name: 2-amino-3-phenyl-N-pyren-2-yl-propanamide CAS Name: 2-amino-3-phenyl-N-(2-pyrenyl)propanamide IUPAC Name: 2-amino-3-phenyl-N-pyren-2-ylpropanamide Traditional Name: 2-amino-3-phenyl-N-pyren-2-yl-propionamide Formula: C25H20N2O MolecularWeight: 364.4391

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2=CC3=C4C(=C2)C=CC5=C4C(=CC=C5)C=C3)N

InChI

InChI=1S/C25H20N2O/c26-22(13-16-5-2-1-3-6-16)25(28)27-21-14-19-11-9-17-7-4-8-18-10-12-20(15-21)24(19)23(17)18/h1-12,14-15,22H,13,26H2,(H,27,28)