N-[(1R)-1-(1-adamantyl)ethyl]-5-nitro-quinolin-8-amine

Systemtic Name: N-[(1R)-1-(1-adamantyl)ethyl]-5-nitro-quinolin-8-amine Openeye Name: N-[(1R)-1-(1-adamantyl)ethyl]-5-nitro-quinolin-8-amine CAS Name: N-[(1R)-1-(1-adamantyl)ethyl]-5-nitro-8-quinolinamine IUPAC Name: N-[(1R)-1-(1-adamantyl)ethyl]-5-nitroquinolin-8-amine Traditional Name: [(1R)-1-(1-adamantyl)ethyl]-(5-nitro-8-quinolyl)amine Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=N5

Isomeric SMILES

C[C@H](C12CC3CC(C1)CC(C3)C2)NC4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=N5

InChI

InChI=1S/C21H25N3O2/c1-13(21-10-14-7-15(11-21)9-16(8-14)12-21)23-18-4-5-19(24(25)26)17-3-2-6-22-20(17)18/h2-6,13-16,23H,7-12H2,1H3/t13-,14?,15?,16?,21?/m1/s1