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

Systemtic Name: 1-methyl-7-(3-piperazin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione Openeye Name: 1-methyl-7-(3-piperazin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione CAS Name: 1-methyl-7-[3-(1-piperazinyl)propylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione IUPAC Name: 1-methyl-7-(3-piperazin-1-ylpropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-dione Traditional Name: 1-methyl-7-(3-piperazinopropylamino)-14H-naphtho[3,2-a]phenoxazine-8,13-quinone Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC3=C(N2)C4=C(C(=C3)NCCCN5CCNCC5)C(=O)C6=CC=CC=C6C4=O

Isomeric SMILES

CC1=C2C(=CC=C1)OC3=C(N2)C4=C(C(=C3)NCCCN5CCNCC5)C(=O)C6=CC=CC=C6C4=O

InChI

InChI=1S/C28H28N4O3/c1-17-6-4-9-21-25(17)31-26-22(35-21)16-20(30-10-5-13-32-14-11-29-12-15-32)23-24(26)28(34)19-8-3-2-7-18(19)27(23)33/h2-4,6-9,16,29-31H,5,10-15H2,1H3