ethyl 4-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: ethyl 4-[[4-(azepan-1-ylsulfonyl)phenyl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl 4-[4-(azepan-1-ylsulfonyl)anilino]-4-oxo-but-2-enoate CAS Name: 4-[4-(1-azepanylsulfonyl)anilino]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl 4-[4-(azepan-1-ylsulfonyl)anilino]-4-oxobut-2-enoate Traditional Name: 4-[4-(azepan-1-ylsulfonyl)anilino]-4-keto-but-2-enoic acid ethyl ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCOC(=O)C=CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C18H24N2O5S/c1-2-25-18(22)12-11-17(21)19-15-7-9-16(10-8-15)26(23,24)20-13-5-3-4-6-14-20/h7-12H,2-6,13-14H2,1H3,(H,19,21)