(Z)-3-[1-[2-(1-methylindol-3-yl)ethanoyl-prop-2-enyl-carbamoyl]cyclopropyl]-1-oxidanyl-3-oxidanylidene-1-phenylmethoxy-prop-1-ene-2-diazonium

Systemtic Name: (Z)-3-[1-[2-(1-methylindol-3-yl)ethanoyl-prop-2-enyl-carbamoyl]cyclopropyl]-1-oxidanyl-3-oxidanylidene-1-phenylmethoxy-prop-1-ene-2-diazonium Openeye Name: (Z)-3-[1-[allyl-[2-(1-methylindol-3-yl)acetyl]carbamoyl]cyclopropyl]-1-benzyloxy-1-hydroxy-3-oxo-prop-1-ene-2-diazonium CAS Name: (Z)-1-hydroxy-3-[1-[[[2-(1-methyl-3-indolyl)-1-oxoethyl]-prop-2-enylamino]-oxomethyl]cyclopropyl]-3-oxo-1-phenylmethoxy-1-propene-2-diazonium IUPAC Name: (Z)-1-hydroxy-3-[1-[[2-(1-methylindol-3-yl)acetyl]-prop-2-enylcarbamoyl]cyclopropyl]-3-oxo-1-phenylmethoxyprop-1-ene-2-diazonium Traditional Name: (Z)-3-[1-[allyl-[2-(1-methylindol-3-yl)acetyl]carbamoyl]cyclopropyl]-1-benzoxy-1-hydroxy-3-keto-prop-1-ene-2-diazonium Formula: C28H27N4O5+ MolecularWeight: 499.53778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CC(=O)N(CC=C)C(=O)C3(CC3)C(=O)C(=C(O)OCC4=CC=CC=C4)[N+]#N

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CC(=O)N(CC=C)C(=O)C3(CC3)C(=O)/C(=C(\O)/OCC4=CC=CC=C4)/[N+]#N

InChI

InChI=1S/C28H26N4O5/c1-3-15-32(23(33)16-20-17-31(2)22-12-8-7-11-21(20)22)27(36)28(13-14-28)25(34)24(30-29)26(35)37-18-19-9-5-4-6-10-19/h3-12,17H,1,13-16,18H2,2H3/p+1