3-tert-butyl-7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione

Systemtic Name: 3-tert-butyl-7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione Openeye Name: 3-tert-butyl-7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione CAS Name: 3-tert-butyl-7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione IUPAC Name: 3-tert-butyl-7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-dione Traditional Name: 3-tert-butyl-7-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propylamino]-14H-naphtho[3,2-a]phenoxazine-8,13-quinone Formula: C36H35N3O3 MolecularWeight: 557.6814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC3=C(O2)C=C(C4=C3C(=O)C5=CC=CC=C5C4=O)NCCCN6CCC7=CC=CC=C7C6

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC3=C(O2)C=C(C4=C3C(=O)C5=CC=CC=C5C4=O)NCCCN6CCC7=CC=CC=C7C6

InChI

InChI=1S/C36H35N3O3/c1-36(2,3)24-13-14-27-29(19-24)42-30-20-28(37-16-8-17-39-18-15-22-9-4-5-10-23(22)21-39)31-32(33(30)38-27)35(41)26-12-7-6-11-25(26)34(31)40/h4-7,9-14,19-20,37-38H,8,15-18,21H2,1-3H3