2-(1,4,4a,8a-tetrahydronaphthalen-1-yl)-4-azanyl-1-(3-azanylpropylamino)-6-phenyl-hexan-3-one

Systemtic Name: 2-(1,4,4a,8a-tetrahydronaphthalen-1-yl)-4-azanyl-1-(3-azanylpropylamino)-6-phenyl-hexan-3-one Openeye Name: 2-(1,4,4a,8a-tetrahydronaphthalen-1-yl)-4-amino-1-(3-aminopropylamino)-6-phenyl-hexan-3-one CAS Name: 2-(1,4,4a,8a-tetrahydronaphthalen-1-yl)-4-amino-1-(3-aminopropylamino)-6-phenyl-3-hexanone IUPAC Name: 2-(1,4,4a,8a-tetrahydronaphthalen-1-yl)-4-amino-1-(3-aminopropylamino)-6-phenylhexan-3-one Traditional Name: 2-(1,4,4a,8a-tetrahydronaphthalen-1-yl)-4-amino-1-(3-aminopropylamino)-6-phenyl-hexan-3-one Formula: C25H35N3O MolecularWeight: 393.5649

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C2C1C=CC=C2)C(CNCCCN)C(=O)C(CCC3=CC=CC=C3)N

Isomeric SMILES

C1C=CC(C2C1C=CC=C2)C(CNCCCN)C(=O)C(CCC3=CC=CC=C3)N

InChI

InChI=1S/C25H35N3O/c26-16-7-17-28-18-23(22-13-6-11-20-10-4-5-12-21(20)22)25(29)24(27)15-14-19-8-2-1-3-9-19/h1-6,8-10,12-13,20-24,28H,7,11,14-18,26-27H2