2-methyl-7-(3-pyrrolidin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione

Systemtic Name: 2-methyl-7-(3-pyrrolidin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione Openeye Name: 2-methyl-7-(3-pyrrolidin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione CAS Name: 2-methyl-7-[3-(1-pyrrolidinyl)propylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione IUPAC Name: 2-methyl-7-(3-pyrrolidin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione Traditional Name: 2-methyl-7-(3-pyrrolidinopropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-quinone Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(N2)C4=C(C(=C3)NCCCN5CCCC5)C(=O)C6=CC=CC=C6C4=O

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(N2)C4=C(C(=C3)NCCCN5CCCC5)C(=O)C6=CC=CC=C6C4=O

InChI

InChI=1S/C28H27N3O3/c1-17-9-10-22-20(15-17)30-26-23(34-22)16-21(29-11-6-14-31-12-4-5-13-31)24-25(26)28(33)19-8-3-2-7-18(19)27(24)32/h2-3,7-10,15-16,29-30H,4-6,11-14H2,1H3