N-[(1R)-1-(1-adamantyl)ethyl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-(2-nitroanilino)propanamide CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-(2-nitroanilino)propanamide Traditional Name: N-[(1R)-1-(1-adamantyl)ethyl]-3-(2-nitroanilino)propionamide Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)CCNC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CCNC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H29N3O3/c1-14(21-11-15-8-16(12-21)10-17(9-15)13-21)23-20(25)6-7-22-18-4-2-3-5-19(18)24(26)27/h2-5,14-17,22H,6-13H2,1H3,(H,23,25)/t14-,15?,16?,17?,21?/m1/s1