[3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]-xanthen-9-ylidene-azanium

Systemtic Name: [3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]-xanthen-9-ylidene-azanium Openeye Name: [3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]-xanthen-9-ylidene-ammonium CAS Name: [[1-oxo-3-(1,2,3,4-tetrahydrocarbazol-9-yl)propyl]amino]-(9-xanthenylidene)ammonium IUPAC Name: [3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]-xanthen-9-ylideneazanium Traditional Name: [3-(1,2,3,4-tetrahydrocarbazol-9-yl)propanoylamino]-xanthen-9-ylidene-ammonium Formula: C28H26N3O2+ MolecularWeight: 436.52494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=CC=CC=C3N2CCC(=O)N[NH+]=C4C5=CC=CC=C5OC6=CC=CC=C64

Isomeric SMILES

C1CCC2=C(C1)C3=CC=CC=C3N2CCC(=O)N[NH+]=C4C5=CC=CC=C5OC6=CC=CC=C64

InChI

InChI=1S/C28H25N3O2/c32-27(17-18-31-23-13-5-1-9-19(23)20-10-2-6-14-24(20)31)29-30-28-21-11-3-7-15-25(21)33-26-16-8-4-12-22(26)28/h1,3-5,7-9,11-13,15-16H,2,6,10,14,17-18H2,(H,29,32)/p+1