4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]butanamide

Systemtic Name: 4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]butanamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)piperidin-1-ium-4-yl]-4-indan-5-yl-4-oxo-butanamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidin-1-iumyl]-4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-1-ium-4-yl]-4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)piperidin-1-ium-4-yl]-4-indan-5-yl-4-keto-butyramide Formula: C26H32N3O3+ MolecularWeight: 434.55058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)NC3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)NC3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O3/c30-24(21-10-9-19-5-4-6-20(19)17-21)11-12-25(31)27-23-13-15-29(16-14-23)18-26(32)28-22-7-2-1-3-8-22/h1-3,7-10,17,23H,4-6,11-16,18H2,(H,27,31)(H,28,32)/p+1