[(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]-pyren-2-yl-methanone

Systemtic Name: [(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]-pyren-2-yl-methanone Openeye Name: [(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]-pyren-2-yl-methanone CAS Name: [(2S)-1-[(1R)-1-phenylethyl]-2-aziridinyl]-(2-pyrenyl)methanone IUPAC Name: [(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]-pyren-2-ylmethanone Traditional Name: [(2S)-1-[(1R)-1-phenylethyl]ethylenimin-2-yl]-pyren-2-yl-methanone Formula: C27H21NO MolecularWeight: 375.46174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CC2C(=O)C3=CC4=C5C(=C3)C=CC6=C5C(=CC=C6)C=C4

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C[C@H]2C(=O)C3=CC4=C5C(=C3)C=CC6=C5C(=CC=C6)C=C4

InChI

InChI=1S/C27H21NO/c1-17(18-6-3-2-4-7-18)28-16-24(28)27(29)23-14-21-12-10-19-8-5-9-20-11-13-22(15-23)26(21)25(19)20/h2-15,17,24H,16H2,1H3/t17-,24+,28?/m1/s1