3-[2-chloranyl-7-[(propan-2-ylamino)methyl]naphthalen-1-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-[2-chloranyl-7-[(propan-2-ylamino)methyl]naphthalen-1-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[2-chloro-7-[(isopropylamino)methyl]-1-naphthyl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione CAS Name: 3-[2-chloro-7-[(propan-2-ylamino)methyl]-1-naphthalenyl]-4-(1-methyl-3-indolyl)pyrrole-2,5-dione IUPAC Name: 3-[2-chloro-7-[(propan-2-ylamino)methyl]naphthalen-1-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[2-chloro-7-[(isopropylamino)methyl]-1-naphthyl]-4-(1-methylindol-3-yl)-3-pyrroline-2,5-quinone Formula: C27H24ClN3O2 MolecularWeight: 457.95136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC1=CC2=C(C=C1)C=CC(=C2C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)C)Cl

Isomeric SMILES

CC(C)NCC1=CC2=C(C=C1)C=CC(=C2C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)C)Cl

InChI

InChI=1S/C27H24ClN3O2/c1-15(2)29-13-16-8-9-17-10-11-21(28)23(19(17)12-16)25-24(26(32)30-27(25)33)20-14-31(3)22-7-5-4-6-18(20)22/h4-12,14-15,29H,13H2,1-3H3,(H,30,32,33)