5,6-bis(azanyl)-8-[bis(prop-2-enyl)amino]-3-[2-(cyclohexen-1-yl)ethyl]-2-oxidanylidene-1H-pyrrolo[2,3-c][2,7]naphthyridin-7-ium-9-carbonitrile

Systemtic Name: 5,6-bis(azanyl)-8-[bis(prop-2-enyl)amino]-3-[2-(cyclohexen-1-yl)ethyl]-2-oxidanylidene-1H-pyrrolo[2,3-c][2,7]naphthyridin-7-ium-9-carbonitrile Openeye Name: 5,6-diamino-3-[2-(cyclohexen-1-yl)ethyl]-8-(diallylamino)-2-oxo-1H-pyrrolo[2,3-c][2,7]naphthyridin-7-ium-9-carbonitrile CAS Name: 5,6-diamino-8-[bis(prop-2-enyl)amino]-3-[2-(1-cyclohexenyl)ethyl]-2-oxo-1H-pyrrolo[2,3-c][2,7]naphthyridin-7-ium-9-carbonitrile IUPAC Name: 5,6-diamino-8-[bis(prop-2-enyl)amino]-3-[2-(cyclohexen-1-yl)ethyl]-2-oxo-1H-pyrrolo[2,3-c][2,7]naphthyridin-7-ium-9-carbonitrile Traditional Name: 5,6-diamino-3-[2-(cyclohexen-1-yl)ethyl]-8-(diallylamino)-2-keto-1H-pyrrolo[2,3-c][2,7]naphthyridin-7-ium-9-carbonitrile Formula: C25H30N7O+ MolecularWeight: 444.552

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=C)C1=[NH+]C(=C2C(=C1C#N)C3=C(N=C2N)N(C(=O)C3)CCC4=CCCCC4)N

Isomeric SMILES

C=CCN(CC=C)C1=[NH+]C(=C2C(=C1C#N)C3=C(N=C2N)N(C(=O)C3)CCC4=CCCCC4)N

InChI

InChI=1S/C25H29N7O/c1-3-11-31(12-4-2)24-18(15-26)20-17-14-19(33)32(13-10-16-8-6-5-7-9-16)25(17)30-23(28)21(20)22(27)29-24/h3-4,8H,1-2,5-7,9-14H2,(H2,27,29)(H2,28,30)/p+1