2-(azepan-1-ylsulfonyl)-N-(cycloheptylideneamino)-4-nitro-aniline

Systemtic Name: 2-(azepan-1-ylsulfonyl)-N-(cycloheptylideneamino)-4-nitro-aniline Openeye Name: 2-(azepan-1-ylsulfonyl)-N-(cycloheptylideneamino)-4-nitro-aniline CAS Name: 2-(1-azepanylsulfonyl)-N-(cycloheptylideneamino)-4-nitroaniline IUPAC Name: 2-(azepan-1-ylsulfonyl)-N-(cycloheptylideneamino)-4-nitroaniline Traditional Name: [2-(azepan-1-ylsulfonyl)-4-nitro-phenyl]-(cycloheptylideneamino)amine Formula: C19H28N4O4S MolecularWeight: 408.51502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCCCCC3)CC1

Isomeric SMILES

C1CCCC(=NNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCCCCC3)CC1

InChI

InChI=1S/C19H28N4O4S/c24-23(25)17-11-12-18(21-20-16-9-5-1-2-6-10-16)19(15-17)28(26,27)22-13-7-3-4-8-14-22/h11-12,15,21H,1-10,13-14H2