butanedioic acid; N-[2-(4-naphthalen-1-ylsulfonyl-2,3-dihydro-1,4-benzoxazin-6-yl)ethyl]-N-propyl-propan-1-amine

Systemtic Name: butanedioic acid; N-[2-(4-naphthalen-1-ylsulfonyl-2,3-dihydro-1,4-benzoxazin-6-yl)ethyl]-N-propyl-propan-1-amine Openeye Name: N-[2-[4-(1-naphthylsulfonyl)-2,3-dihydro-1,4-benzoxazin-6-yl]ethyl]-N-propyl-propan-1-amine; succinic acid CAS Name: butanedioic acid; N-[2-[4-(1-naphthalenylsulfonyl)-2,3-dihydro-1,4-benzoxazin-6-yl]ethyl]-N-propyl-1-propanamine IUPAC Name: butanedioic acid; N-[2-(4-naphthalen-1-ylsulfonyl-2,3-dihydro-1,4-benzoxazin-6-yl)ethyl]-N-propylpropan-1-amine Traditional Name: 2-[4-(1-naphthylsulfonyl)-2,3-dihydro-1,4-benzoxazin-6-yl]ethyl-dipropyl-amine; succinic acid Formula: C30H38N2O7S MolecularWeight: 570.69692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCC1=CC2=C(C=C1)OCCN2S(=O)(=O)C3=CC=CC4=CC=CC=C43.C(CC(=O)O)C(=O)O

Isomeric SMILES

CCCN(CCC)CCC1=CC2=C(C=C1)OCCN2S(=O)(=O)C3=CC=CC4=CC=CC=C43.C(CC(=O)O)C(=O)O

InChI

InChI=1S/C26H32N2O3S.C4H6O4/c1-3-15-27(16-4-2)17-14-21-12-13-25-24(20-21)28(18-19-31-25)32(29,30)26-11-7-9-22-8-5-6-10-23(22)26;5-3(6)1-2-4(7)8/h5-13,20H,3-4,14-19H2,1-2H3;1-2H2,(H,5,6)(H,7,8)