N-(2-diethylaminoethyl)-N-[4-[(E)-1,2-diphenylethenyl]phenyl]butane-1-sulfonamide nitrate

Systemtic Name: N-(2-diethylaminoethyl)-N-[4-[(E)-1,2-diphenylethenyl]phenyl]butane-1-sulfonamide nitrate Openeye Name: N-(2-diethylaminoethyl)-N-[4-[(E)-1,2-diphenylvinyl]phenyl]butane-1-sulfonamide nitrate CAS Name: N-(2-diethylaminoethyl)-N-[4-[(E)-1,2-diphenylethenyl]phenyl]-1-butanesulfonamide nitrate IUPAC Name: N-(2-diethylaminoethyl)-N-[4-[(E)-1,2-diphenylethenyl]phenyl]butane-1-sulfonamide nitrate Traditional Name: N-(2-diethylaminoethyl)-N-[4-[(E)-1,2-diphenylvinyl]phenyl]butane-1-sulfonamide nitrate Formula: C30H38N3O5S- MolecularWeight: 552.70482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N(CCN(CC)CC)C1=CC=C(C=C1)C(=CC2=CC=CC=C2)C3=CC=CC=C3.[N+](=O)([O-])[O-]

Isomeric SMILES

CCCCS(=O)(=O)N(CCN(CC)CC)C1=CC=C(C=C1)/C(=C/C2=CC=CC=C2)/C3=CC=CC=C3.[N+](=O)([O-])[O-]

InChI

InChI=1S/C30H38N2O2S.NO3/c1-4-7-24-35(33,34)32(23-22-31(5-2)6-3)29-20-18-28(19-21-29)30(27-16-12-9-13-17-27)25-26-14-10-8-11-15-26;2-1(3)4/h8-21,25H,4-7,22-24H2,1-3H3;/q;-1/b30-25+;