3-[1-[6-(aminomethyl)oxan-2-yl]indol-3-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-[1-[6-(aminomethyl)oxan-2-yl]indol-3-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[1-[6-(aminomethyl)tetrahydropyran-2-yl]indol-3-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione CAS Name: 3-[1-[6-(aminomethyl)-2-oxanyl]-3-indolyl]-4-(1-methyl-3-indolyl)pyrrole-2,5-dione IUPAC Name: 3-[1-[6-(aminomethyl)oxan-2-yl]indol-3-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[1-[6-(aminomethyl)tetrahydropyran-2-yl]indol-3-yl]-4-(1-methylindol-3-yl)-3-pyrroline-2,5-quinone Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)C6CCCC(O6)CN

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)C6CCCC(O6)CN

InChI

InChI=1S/C27H26N4O3/c1-30-14-19(17-8-2-4-10-21(17)30)24-25(27(33)29-26(24)32)20-15-31(22-11-5-3-9-18(20)22)23-12-6-7-16(13-28)34-23/h2-5,8-11,14-16,23H,6-7,12-13,28H2,1H3,(H,29,32,33)