ethyl (E)-3-[3-[4-(phenylsulfonylamino)butyl]-6-propan-2-yl-azulen-1-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-[4-(phenylsulfonylamino)butyl]-6-propan-2-yl-azulen-1-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[3-[4-(benzenesulfonamido)butyl]-6-isopropyl-azulen-1-yl]prop-2-enoate CAS Name: (E)-3-[3-[4-(benzenesulfonamido)butyl]-6-propan-2-yl-1-azulenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[4-(benzenesulfonamido)butyl]-6-propan-2-ylazulen-1-yl]prop-2-enoate Traditional Name: (E)-3-[3-[4-(benzenesulfonamido)butyl]-6-isopropyl-azulen-1-yl]acrylic acid ethyl ester Formula: C28H33NO4S MolecularWeight: 479.63092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C2C=CC(=CC=C2C(=C1)CCCCNS(=O)(=O)C3=CC=CC=C3)C(C)C

Isomeric SMILES

CCOC(=O)/C=C/C1=C2C=CC(=CC=C2C(=C1)CCCCNS(=O)(=O)C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C28H33NO4S/c1-4-33-28(30)18-15-24-20-23(26-16-13-22(21(2)3)14-17-27(24)26)10-8-9-19-29-34(31,32)25-11-6-5-7-12-25/h5-7,11-18,20-21,29H,4,8-10,19H2,1-3H3/b18-15+