N-[3-[1-oxidanidyl-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenyl]-4-(4-phenylbutoxy)benzamide

Systemtic Name: N-[3-[1-oxidanidyl-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenyl]-4-(4-phenylbutoxy)benzamide Openeye Name: N-[3-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenyl]-4-(4-phenylbutoxy)benzamide CAS Name: N-[3-[1-oxido-2-[(E)-prop-1-enyl]-1-imidazol-1-iumyl]phenyl]-4-(4-phenylbutoxy)benzamide IUPAC Name: N-[3-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenyl]-4-(4-phenylbutoxy)benzamide Traditional Name: N-[3-[1-oxido-2-[(E)-prop-1-enyl]imidazol-1-ium-1-yl]phenyl]-4-(4-phenylbutoxy)benzamide Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=NC=C[N+]1(C2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)OCCCCC4=CC=CC=C4)[O-]

Isomeric SMILES

C/C=C/C1=NC=C[N+]1(C2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)OCCCCC4=CC=CC=C4)[O-]

InChI

InChI=1S/C29H29N3O3/c1-2-9-28-30-19-20-32(28,34)26-14-8-13-25(22-26)31-29(33)24-15-17-27(18-16-24)35-21-7-6-12-23-10-4-3-5-11-23/h2-5,8-11,13-20,22H,6-7,12,21H2,1H3,(H,31,33)/b9-2+