(E)-N-[(1S)-1-(1-adamantyl)ethyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(1S)-1-(1-adamantyl)ethyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[(1S)-1-(1-adamantyl)ethyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[(1S)-1-(1-adamantyl)ethyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[(1S)-1-(1-adamantyl)ethyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(1S)-1-(1-adamantyl)ethyl]-3-(3-nitrophenyl)acrylamide Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3/c1-14(21-11-16-7-17(12-21)9-18(8-16)13-21)22-20(24)6-5-15-3-2-4-19(10-15)23(25)26/h2-6,10,14,16-18H,7-9,11-13H2,1H3,(H,22,24)/b6-5+/t14-,16?,17?,18?,21?/m0/s1